diethyl-[2-[[6-oxidanylidene-7-(phenylmethyl)-3H-purin-2-yl]amino]ethyl]azanium

Systemtic Name: diethyl-[2-[[6-oxidanylidene-7-(phenylmethyl)-3H-purin-2-yl]amino]ethyl]azanium Openeye Name: 2-[(7-benzyl-6-oxo-3H-purin-2-yl)amino]ethyl-diethyl-ammonium CAS Name: diethyl-[2-[[6-oxo-7-(phenylmethyl)-3H-purin-2-yl]amino]ethyl]ammonium IUPAC Name: 2-[(7-benzyl-6-oxo-3H-purin-2-yl)amino]ethyl-diethylazanium Traditional Name: 2-[(7-benzyl-6-keto-3H-purin-2-yl)amino]ethyl-diethyl-ammonium Formula: C18H25N6O+ MolecularWeight: 341.4307

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC1=NC(=O)C2=C(N1)N=CN2CC3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC)CCNC1=NC(=O)C2=C(N1)N=CN2CC3=CC=CC=C3

InChI

InChI=1S/C18H24N6O/c1-3-23(4-2)11-10-19-18-21-16-15(17(25)22-18)24(13-20-16)12-14-8-6-5-7-9-14/h5-9,13H,3-4,10-12H2,1-2H3,(H2,19,21,22,25)/p+1